(2S,5R)-3,7-Dioxo-1,4-diazabicyclo[3.2.0]heptane-2-carboxylic acid
[CAS# 779282-49-4]

Identification

• Name: (2S,5R)-3,7-Dioxo-1,4-diazabicyclo[3.2.0]heptane-2-carboxylic acid
• Synonyms: (2S,5R)-3,7-dioxo-1,4-diazabicyclo[3.2.0]heptane-2-carboxylic acid
• Molecular Formula: C₆H₆N₂O₄
• Molecular Weight: 170.12
• CAS Registry Number: 779282-49-4
• SMILES: C1[C@@H]2NC(=O)[C@H](N2C1=O)C(=O)O
• InChI: 1S/C6H6N2O4/c9-3-1-2-7-5(10)4(6(11)12)8(2)3/h2,4H,1H2,(H,7,10)(H,11,12)/t2-,4+/m1/s1
• InChIKey: CYFQWRHXKQLPKF-FONMRSAGSA-N

Properties

• Density: 1.786g/cm³ (Cal.)
• Boiling point: 677.649°C at 760 mmHg (Cal.)
• Flash point: 363.629°C (Cal.)
• Refractive index: 1.659 (Cal.)